Investigating the effects of hydrostatic pressure on the physical properties of cubic Sr3BCl3 (B= As, Sb) for improved optoelectronic applications: a DFT study
A Hosen - Heliyon, 2024 - cell.com
This article explores changes in the structural, electronic, elastic, and optical properties of
the novel cubic Sr 3 BCl 3 (B= As, Sb) with increasing pressure. This research aims to …
the novel cubic Sr 3 BCl 3 (B= As, Sb) with increasing pressure. This research aims to …
Revealing vibrational, elastic, electro-optic, and thermoelectric aspects of double perovskites Na2ScCuX6 (X= Cl, Br) for energy harvesting applications by …
Currently, the novel combination of double perovskites Na 2 ScCuX 6 (X= Cl, Br) is being
investigated as a potential solution to fulfil the energy requirements. For this purpose, the …
investigated as a potential solution to fulfil the energy requirements. For this purpose, the …
DFT Analysis of Ba2NbRhO6: A Promising Double Perovskite for Sustainable Energy Applications
Our study employed the full-potential linearized augmented plane wave (FP-LAPW)
approach within the density functional theory (DFT) framework to examine the fundamental …
approach within the density functional theory (DFT) framework to examine the fundamental …
A theoretical investigation of the Ba2CePtO6 double perovskite for optoelectronic and thermoelectric applications
In this work, theoretical investigations were performed for the structural, elastic,
optoelectronic, thermodynamic, and thermoelectric characteristics of barium ceroplatinate …
optoelectronic, thermodynamic, and thermoelectric characteristics of barium ceroplatinate …
First-principles studies of structural, vibrational, elastic, optoelectronic, and thermoelectric properties of doped, alloyed, and strained CsGeCl3 for photovoltaic …
M El Akkel, S Dahbi, S Benyoussef, N Tahiri… - Solar Energy, 2024 - Elsevier
Due to their improved Power Conversion Efficiency (PCE), reduced cost, and simplified
manufacturing, perovskite solar cells (PSCs) have recently become increasingly appealing …
manufacturing, perovskite solar cells (PSCs) have recently become increasingly appealing …
Investigating the potential of triclinic ABSe3 (A = Li, Na, K, Rb, Cs; B = Si, Ge, Sn) perovskites as a new class of lead-free photovoltaic materials
In recent years, chalcogenide perovskites have emerged as promising candidates with
favorable structural, electrical, and optical properties for photovoltaic applications. This …
favorable structural, electrical, and optical properties for photovoltaic applications. This …
[HTML][HTML] Optoelectronic and thermoelectric analysis of halide stable double perovskite Rb2TlSbX6 (X= Cl, Br, I) via DFT calculations
To explore a good candidate for solar cell applications as an alternative to lead-independent
materials, we calculated the structural and mechanical stability of the Rb 2 TlSbX 6 (X= Cl …
materials, we calculated the structural and mechanical stability of the Rb 2 TlSbX 6 (X= Cl …
Exploring Silicon-Based Ca2TiSiO6 Ordered Double Perovskite Oxides: a Comprehensive DFT Investigation of Structural, Dynamical, Mechanical Stability, and …
In this research, the structural properties, phonons, mechanical stability, and optoelectronic
properties of silicon-based Ca2TiSiO6 ordered double perovskites oxides are computed …
properties of silicon-based Ca2TiSiO6 ordered double perovskites oxides are computed …
First-principles evaluation of lead-free X2NaIO6 (X= Sr, Ba) Double-Perovskite: for optoelectronic and solar cell applications
The standard lead-free double perovskite X 2 NaIO 6 has become a viable alternative for
lead-based perovskites due to its remarkable optoelectronic capabilities, high stability, non …
lead-based perovskites due to its remarkable optoelectronic capabilities, high stability, non …
Investigating the multifaceted characteristics of Ba2FeWO6 double perovskite: insights from density functional theory
This study undertook a comprehensive examination of the double perovskite complex Ba 2
FeWO 6, investigating its structural, electrical, magnetic, thermal and elastic characteristics …
FeWO 6, investigating its structural, electrical, magnetic, thermal and elastic characteristics …